1-[(3S)-3-pyrrolidin-1-ylcarbonyl-3,4-dihydro-1H-isoquinolin-2-yl]heptane-1,6-dione

Systemtic Name: 1-[(3S)-3-pyrrolidin-1-ylcarbonyl-3,4-dihydro-1H-isoquinolin-2-yl]heptane-1,6-dione Openeye Name: 1-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]heptane-1,6-dione CAS Name: 1-[(3S)-3-[oxo(1-pyrrolidinyl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]heptane-1,6-dione IUPAC Name: 1-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]heptane-1,6-dione Traditional Name: 1-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]heptane-1,6-dione Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCC(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCCC3

Isomeric SMILES

CC(=O)CCCCC(=O)N1CC2=CC=CC=C2C[C@H]1C(=O)N3CCCC3

InChI

InChI=1S/C21H28N2O3/c1-16(24)8-2-5-11-20(25)23-15-18-10-4-3-9-17(18)14-19(23)21(26)22-12-6-7-13-22/h3-4,9-10,19H,2,5-8,11-15H2,1H3/t19-/m0/s1